3,5-Difluorobenzyl chloride → 5-Bromo-1'-{[6-chloro-1-(3,5-difluorobenzyl)-1H-indol-3-yl]carbonyl}-3H-spiro[2-benzofuran-1,4'-piperidin]-3-one

반응식

[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:27][cH:28]1)[C:6]1([O:7][C:8]2=[O:9])[CH2:10][CH2:11][N:12]([C:15](=[O:16])[c:17]2[cH:18][nH:19][c:20]3[cH:21][c:22]([Cl:26])[cH:23][cH:24][c:25]23)[CH2:13][CH2:14]1.[F:29][c:30]1[cH:31][c:32]([CH2:33][Cl:34])[cH:35][c:36]([F:38])[cH:37]1>>[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:27][cH:28]1)[C:6]1([O:7][C:8]2=[O:9])[CH2:10][CH2:11][N:12]([C:15](=[O:16])[c:17]2[cH:18][n:19]([CH2:33][c:32]3[cH:31][c:30]([F:29])[cH:37][c:36]([F:38])[cH:35]3)[c:20]3[cH:21][c:22]([Cl:26])[cH:23][cH:24][c:25]23)[CH2:13][CH2:14]1

참가 물질

반응물 2

HCID 27369553,5-Difluorobenzyl chloride

HCID 596576195-bromo-1'-[(6-chloro-1H-indol-3-yl)carbonyl]-3H-spiro[2-benzofuran-1,4'-piperidin]-3-one

생성물 1

HCID 596576705-Bromo-1'-{[6-chloro-1-(3,5-difluorobenzyl)-1H-indol-3-yl]carbonyl}-3H-spiro[2-benzofuran-1,4'-piperidin]-3-one

출처 및 근거

ORD 기록: ord-7a808f2c109b488a83c7a9e4ed0404ad
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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